The phenomenon of self-polarization in sputtered lead zirconate titanate (P
ZT) thin films was analyzed. Vacancy formation enthalpies of PZT compounds
were estimated for the first time considering a significant amount of coval
ent binding in PZT crystals. The mobility of vacancies was estimated by a b
allistic migration process with a jump time inversely proportional to the p
honon frequency. A value as low as 0.12 eV results for the oxygen vacancy e
nthalpy of migration, which is also responsible for fatigue in PZT capacito
rs in silicon microelectronic dynamic random access memories. (C) 1999 Else
vier Science S.A. All rights reserved.